SCHEMBL7684484

SCHEMBL7684484

CC=C(C(=O)SC)c1ccccc1CBr

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.31
BCAT2 O15382 1/20 0.31
TSHR P16473 2/20 0.31
FOLH1 Q04609 1/20 0.31
PTPN1 P18031 1/20 0.30
MAPT P10636 2/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7459530 0.81 FOLH1 (0.37) LMNAALDH1A1TSHRFOLH1PTPN1
SCHEMBL3459412 0.81 FOLH1 (0.37) LMNAALDH1A1TSHRFOLH1PTPN1
SCHEMBL7691197 0.80 FOLH1 (0.36) LMNAALDH1A1HPGDTSHRFOLH1
SCHEMBL7691194 0.77 ERCC5 (0.36) LMNAALDH1A1KMT2AFOLH1PTPN1
SCHEMBL8035923 0.77 ALDH1A1 (0.43) LMNAALDH1A1MEN1KMT2AHPGD
SCHEMBL6156562 0.77 ALDH1A1 (0.43) LMNAALDH1A1MEN1KMT2AHPGD
SCHEMBL5669568 0.77 ALDH1A1 (0.43) LMNAALDH1A1MEN1KMT2AHPGD
SCHEMBL10613851 0.75 MEN1 (0.47) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL7684480 0.74 ALDH1A1 (0.40) LMNAALDH1A1MEN1KMT2AHPGD
SCHEMBL8227007 0.71 ALDH1A1 (0.44) LMNAALDH1A1MEN1KMT2AHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407100-B1 HORTICULTURE, AGRICULTURE, WOOD PRESERVATION BAYER AKTIENGESELLSCHAFT (DE) 2002-06-18 US disclosed
US-6355634-B1 OXIME DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2002-03-12 US disclosed